4-[[(E)-2-(furan-2-ylcarbonylamino)-3-phenyl-prop-2-enoyl]amino]butanoic acid

Systemtic Name: 4-[[(E)-2-(furan-2-ylcarbonylamino)-3-phenyl-prop-2-enoyl]amino]butanoic acid Openeye Name: 4-[[(E)-2-(furan-2-carbonylamino)-3-phenyl-prop-2-enoyl]amino]butanoic acid CAS Name: 4-[[(E)-2-[[2-furanyl(oxo)methyl]amino]-1-oxo-3-phenylprop-2-enyl]amino]butanoic acid IUPAC Name: 4-[[(E)-2-(furan-2-carbonylamino)-3-phenylprop-2-enoyl]amino]butanoic acid Traditional Name: 4-[[(E)-2-(2-furoylamino)-3-phenyl-acryloyl]amino]butyric acid Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=C(C(=O)NCCCC(=O)O)NC(=O)C2=CC=CO2

Isomeric SMILES

C1=CC=C(C=C1)/C=C(\C(=O)NCCCC(=O)O)/NC(=O)C2=CC=CO2

InChI

InChI=1S/C18H18N2O5/c21-16(22)9-4-10-19-17(23)14(12-13-6-2-1-3-7-13)20-18(24)15-8-5-11-25-15/h1-3,5-8,11-12H,4,9-10H2,(H,19,23)(H,20,24)(H,21,22)/b14-12+